SCHEMBL5680205

SCHEMBL5680205

Cc1ccc(C[C](Cc2ccc(Cl)cc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.57
RAB9A P51151 4/20 0.57
NPC1 O15118 3/20 0.57
MEN1 O00255 7/20 0.49
KMT2A Q03164 7/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPT P10636 1/20 0.47
XBP1 P17861 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CNR2 P34972 1/20 0.45
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
CES2 O00748 3/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7767316 0.83 L3MBTL1 (0.66) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL6985793 0.83 KMT2A (0.53) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL8672567 0.76 CES1 (0.52) L3MBTL1MEN1KMT2AALDH1A1MAPT
SCHEMBL6309158 0.76 L3MBTL1 (0.52) L3MBTL1RAB9ANPC1MEN1KMT2A
Chlorobenzene SCHEMBL28302077 0.75 L3MBTL1 (0.57) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL29271945 0.75 L3MBTL1 (0.50) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL1129900 0.75 L3MBTL1 (0.55) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL2299272 0.73 L3MBTL1 (0.49) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL6224695 0.73 RAB9A (1.00) L3MBTL1RAB9ANPC1MEN1KMT2A
SCHEMBL6199337 0.73 RAB9A (1.00) L3MBTL1RAB9ANPC1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414426-B1 CARBOCYCLIC HYDRAZINO INHIBITORS OF COPPER-CONTAINING AMINE OXIDASES BIOTIE THERAPIES CORP (FI) 2006-03-01 EP disclosed
US-20040236108-A1 Carbocyclic hydrazino inhibitors of copper-containing amine oxidases BIOTIE THERAPIES CORPORATION (FI) 2004-11-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040236108-A1 Carbocyclic hydrazino inhibitors of copper-containing amine oxidases AOC2, VCAM1, AOC3 L3MBTL1 3641/4885RAB9A 3658/4885NPC1 1232/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.